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SCHEMBL29901070

SCHEMBL29901070

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)[C@@H](C)CC)C(=O)NCC(=O)O

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 3/20 0.65
▸ MC5R P33032 2/20 0.65
▸ MC3R P41968 2/20 0.65
▸ MC1R Q01726 2/20 0.65
▸ NPY1R P25929 1/20 0.63
▸ NPY2R P49146 1/20 0.63
▸ NPY4R P50391 1/20 0.63
▸ NPY5R Q15761 1/20 0.63
▸ CXCR4 P61073 6/20 0.62
▸ IL23R Q5VWK5 2/20 0.61
▸ C5AR1 P21730 1/20 0.60
▸ GLP1R P43220 5/20 0.58
▸ CXCL8 P10145 1/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Edratide SCHEMBL29355439 0.97 IL23R (0.62) MC4RMC5RMC3RMC1RNPY1R
SCHEMBL30607498 0.89 NPY2R (0.70) MC4RMC5RMC3RMC1RNPY1R
SCHEMBL30906368 0.89 NPY2R (0.65) NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL31683320 0.88 NPY2R (0.73) NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30618038 0.88 IL23R (0.67) MC4RMC5RMC3RMC1RNPY1R
SCHEMBL30906424 0.88 NPY2R (0.70) NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30721554 0.87 NPY2R (0.76) NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30494418 0.87 NPY2R (0.67) NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30658239 0.86 NPY1R (0.69) NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30712911 0.85 NPY1R (0.61) NPY1RNPY2RNPY4RNPY5RCXCR4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4302098-A1 SYSTEMS AND METHODS FOR QUANTIFYING AND MODIFYING PROTEIN VISCOSITY Regeneron Pharmaceuticals, Inc. (US) 2024-01-10 — — EP disclosed
CN-110139659-B Peptides for the treatment of sjogren's syndrome 耶达研究及发展有限公司 2023-07-28 — — CN disclosed
US-20220404369-A1 SYSTEMS AND METHODS FOR QUANTIFYING AND MODIFYING PROTEIN VISCOSITY REGENERON PHARMACEUTICALS, INC. 2022-12-22 — — US disclosed
EP-4090685-A1 ANTI-GAL3 ANTIBODIES AND METHODS OF USE TrueBinding, Inc. (US) 2022-11-23 — — EP disclosed
WO-2022187323-A1 SYSTEMS AND METHODS FOR QUANTIFYING AND MODIFYING PROTEIN VISCOSITY REGENERON PHARMACEUTICALS, INC. (US) 2022-09-09 — — WO disclosed
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